6-amino-N-(5-propyl-1H-pyrazol-3-yl)pyridine-3-sulfonamide

C11H15N5O2S — CID 104616839

IUPAC6-amino-N-(5-propyl-1H-pyrazol-3-yl)pyridine-3-sulfonamide
SMILESCCCc1cc(NS(=O)(=O)c2ccc(N)nc2)n[nH]1
InChIInChI=1S/C11H15N5O2S/c1-2-3-8-6-11(15-14-8)16-19(17,18)9-4-5-10(12)13-7-9/h4-7H,2-3H2,1H3,(H2,12,13)(H2,14,15,16)
InChIKeyBILKZOMIWRRRLB-UHFFFAOYSA-N
MW281.34 g/mol
LogP1.14
Rot. Bonds5

About 6-amino-N-(5-propyl-1H-pyrazol-3-yl)pyridine-3-sulfonamide

6-amino-N-(5-propyl-1H-pyrazol-3-yl)pyridine-3-sulfonamide (PubChem CID 104616839) has the molecular formula C11H15N5O2S and a molecular weight of 281.34 g/mol. Its IUPAC name is 6-amino-N-(5-propyl-1H-pyrazol-3-yl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-amino-N-(5-propyl-1H-pyrazol-3-yl)pyridine-3-sulfonamide
PubChem CID104616839
Molecular FormulaC11H15N5O2S
Molecular Weight281.34 g/mol
Exact Mass281.09
IUPAC Name6-amino-N-(5-propyl-1H-pyrazol-3-yl)pyridine-3-sulfonamide
SMILESCCCc1cc(NS(=O)(=O)c2ccc(N)nc2)n[nH]1
InChIInChI=1S/C11H15N5O2S/c1-2-3-8-6-11(15-14-8)16-19(17,18)9-4-5-10(12)13-7-9/h4-7H,2-3H2,1H3,(H2,12,13)(H2,14,15,16)
InChIKeyBILKZOMIWRRRLB-UHFFFAOYSA-N
XLogP1.14
TPSA113.76 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.34
LogP ≤ 51.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-amino-N-(5-propyl-1H-pyrazol-3-yl)pyridine-3-sulfonamide?
The IUPAC name of 6-amino-N-(5-propyl-1H-pyrazol-3-yl)pyridine-3-sulfonamide (CID 104616839) is 6-amino-N-(5-propyl-1H-pyrazol-3-yl)pyridine-3-sulfonamide.
What is the SMILES notation for 6-amino-N-(5-propyl-1H-pyrazol-3-yl)pyridine-3-sulfonamide?
The canonical SMILES for 6-amino-N-(5-propyl-1H-pyrazol-3-yl)pyridine-3-sulfonamide is CCCc1cc(NS(=O)(=O)c2ccc(N)nc2)n[nH]1.
What is the InChIKey of 6-amino-N-(5-propyl-1H-pyrazol-3-yl)pyridine-3-sulfonamide?
The InChIKey is BILKZOMIWRRRLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5O2S/c1-2-3-8-6-11(15-14-8)16-19(17,18)9-4-5-10(12)13-7-9/h4-7H,2-3H2,1H3,(H2,12,13)(H2,14,15,16).
What are the key properties of 6-amino-N-(5-propyl-1H-pyrazol-3-yl)pyridine-3-sulfonamide?
6-amino-N-(5-propyl-1H-pyrazol-3-yl)pyridine-3-sulfonamide has a molecular weight of 281.34 g/mol, XLogP of 1.14, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-(5-propyl-1H-pyrazol-3-yl)pyridine-3-sulfonamide is sourced from PubChem (CID 104616839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).